propane trihydroxide

C3H11O3-3 — CID 18172989

IUPACpropane trihydroxide
SMILESCCC.[OH-].[OH-].[OH-]
InChIInChI=1S/C3H8.3H2O/c1-3-2;;;/h3H2,1-2H3;3*1H2/p-3
InChIKeyQOGXKTYUDMTWSC-UHFFFAOYSA-K
MW95.12 g/mol
LogP0.89
Rot. Bonds

About propane trihydroxide

propane trihydroxide (PubChem CID 18172989) has the molecular formula C3H11O3-3 and a molecular weight of 95.12 g/mol. Its IUPAC name is propane trihydroxide.

Molecular Properties

Compound Namepropane trihydroxide
PubChem CID18172989
Molecular FormulaC3H11O3-3
Molecular Weight95.12 g/mol
Exact Mass95.07
IUPAC Namepropane trihydroxide
SMILESCCC.[OH-].[OH-].[OH-]
InChIInChI=1S/C3H8.3H2O/c1-3-2;;;/h3H2,1-2H3;3*1H2/p-3
InChIKeyQOGXKTYUDMTWSC-UHFFFAOYSA-K
XLogP0.89
TPSA90.00 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50095.12
LogP ≤ 50.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

Propane--water (1/1)
CID 18541607
Hydroxy-oxo-propan-2-yltin
CID 135049255
Hydrogen peroxide;propane
CID 18348147
Oxygen(2-);propane;titanium(4+);hydroxide
CID 20258730
Hydroxy(oxo)titanium;propane
CID 22989388
Propane;dihydrate
CID 57455378
Propane;titanium;dihydrate
CID 87753375
Oxotitanium(1+);propane;hydrate
CID 88697820
Propane;titanium;trihydrate
CID 139799968
Iodic acid;propane
CID 157427150
Propane;titanium;dihydrate
CID 157521395
Ethane;dihydrate
CID 160377839

Frequently Asked Questions

What is the IUPAC name of propane trihydroxide?
The IUPAC name of propane trihydroxide (CID 18172989) is propane trihydroxide.
What is the SMILES notation for propane trihydroxide?
The canonical SMILES for propane trihydroxide is CCC.[OH-].[OH-].[OH-].
What is the InChIKey of propane trihydroxide?
The InChIKey is QOGXKTYUDMTWSC-UHFFFAOYSA-K. The full InChI is InChI=1S/C3H8.3H2O/c1-3-2;;;/h3H2,1-2H3;3*1H2/p-3.
What are the key properties of propane trihydroxide?
propane trihydroxide has a molecular weight of 95.12 g/mol, XLogP of 0.89, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for propane trihydroxide is sourced from PubChem (CID 18172989), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).